N-{3-[(propan-2-yl)oxy]propyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
N-{3-[(propan-2-yl)oxy]propyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
N-{3-[(propan-2-yl)oxy]propyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D034-0265 |
| Compound Name: | N-{3-[(propan-2-yl)oxy]propyl}-2-(1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C15 H20 N2 O5 S |
| Smiles: | CC(C)OCCCNC(CN1C(c2ccccc2S1(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0701 |
| logD: | 0.0701 |
| logSw: | -2.4142 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.969 |
| InChI Key: | SEOUHMBGCFTNNX-UHFFFAOYSA-N |